N-(2-benzoyl-4-chlorophenyl)-2-phenoxyacetamide

C21H16ClNO3 — CID 1019206

IUPACN-(2-benzoyl-4-chlorophenyl)-2-phenoxyacetamide
SMILESO=C(COc1ccccc1)Nc1ccc(Cl)cc1C(=O)c1ccccc1
InChIInChI=1S/C21H16ClNO3/c22-16-11-12-19(18(13-16)21(25)15-7-3-1-4-8-15)23-20(24)14-26-17-9-5-2-6-10-17/h1-13H,14H2,(H,23,24)
InChIKeyNRKMGDQWAVWEME-UHFFFAOYSA-N
MW365.82 g/mol
LogP4.59
Rot. Bonds6

About N-(2-benzoyl-4-chlorophenyl)-2-phenoxyacetamide

N-(2-benzoyl-4-chlorophenyl)-2-phenoxyacetamide (PubChem CID 1019206) has the molecular formula C21H16ClNO3 and a molecular weight of 365.82 g/mol. Its IUPAC name is N-(2-benzoyl-4-chlorophenyl)-2-phenoxyacetamide.

Molecular Properties

Compound NameN-(2-benzoyl-4-chlorophenyl)-2-phenoxyacetamide
PubChem CID1019206
Molecular FormulaC21H16ClNO3
Molecular Weight365.82 g/mol
Exact Mass365.08
IUPAC NameN-(2-benzoyl-4-chlorophenyl)-2-phenoxyacetamide
SMILESO=C(COc1ccccc1)Nc1ccc(Cl)cc1C(=O)c1ccccc1
InChIInChI=1S/C21H16ClNO3/c22-16-11-12-19(18(13-16)21(25)15-7-3-1-4-8-15)23-20(24)14-26-17-9-5-2-6-10-17/h1-13H,14H2,(H,23,24)
InChIKeyNRKMGDQWAVWEME-UHFFFAOYSA-N
XLogP4.59
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.82
LogP ≤ 54.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-benzoyl-4-chlorophenyl)-2-phenoxyacetamide?
The IUPAC name of N-(2-benzoyl-4-chlorophenyl)-2-phenoxyacetamide (CID 1019206) is N-(2-benzoyl-4-chlorophenyl)-2-phenoxyacetamide.
What is the SMILES notation for N-(2-benzoyl-4-chlorophenyl)-2-phenoxyacetamide?
The canonical SMILES for N-(2-benzoyl-4-chlorophenyl)-2-phenoxyacetamide is O=C(COc1ccccc1)Nc1ccc(Cl)cc1C(=O)c1ccccc1.
What is the InChIKey of N-(2-benzoyl-4-chlorophenyl)-2-phenoxyacetamide?
The InChIKey is NRKMGDQWAVWEME-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H16ClNO3/c22-16-11-12-19(18(13-16)21(25)15-7-3-1-4-8-15)23-20(24)14-26-17-9-5-2-6-10-17/h1-13H,14H2,(H,23,24).
What are the key properties of N-(2-benzoyl-4-chlorophenyl)-2-phenoxyacetamide?
N-(2-benzoyl-4-chlorophenyl)-2-phenoxyacetamide has a molecular weight of 365.82 g/mol, XLogP of 4.59, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-benzoyl-4-chlorophenyl)-2-phenoxyacetamide is sourced from PubChem (CID 1019206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).